Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 5/20 | 0.56 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.56 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ITGB1 | P05556 | 4/20 | 0.46 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL895907 | 0.94 | HCRTR1 (0.53) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL10173557 | 0.94 | HCRTR1 (0.53) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL10173435 | 0.90 | HCRTR1 (0.50) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL10173644 | 0.90 | HCRTR1 (0.50) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL17613192 | 0.90 | HCRTR1 (0.50) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL16309223 | 0.89 | HCRTR1 (0.49) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL17044979 | 0.89 | HCRTR1 (0.49) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL17044953 | 0.89 | HCRTR1 (0.49) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL22352068 | 0.89 | HCRTR1 (0.49) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 | |
| SCHEMBL16188355 | 0.88 | HCRTR1 (0.48) | HCRTR1HCRTR2SLC2A1ALDH1A1ITGB1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2410844-B1 | INHIBITORS OF HEPATITIS C VIRUS REPLICATION | MERCK SHARP & DOHME (US) | 2016-03-23 | — | — | EP | disclosed |